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Glycine,N-isobutoxycarbonyl-, pentafluorophenylmethyl ester
SpectraBase Compound ID 7dBkP2jWn6X
InChI InChI=1S/C14H14F5NO4/c1-6(2)4-24-14(22)20-3-8(21)23-5-7-9(15)11(17)13(19)12(18)10(7)16/h6H,3-5H2,1-2H3,(H,20,22)
InChIKey QZFYPJXEPFOLTD-UHFFFAOYSA-N
Mol Weight 355.26 g/mol
Molecular Formula C14H14F5NO4
Exact Mass 355.084299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRifqSXdxry
Name Glycine,N-isobutoxycarbonyl-, pentafluorophenylmethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.084298746 u
Formula C14H14F5NO4
InChI InChI=1S/C14H14F5NO4/c1-6(2)4-24-14(22)20-3-8(21)23-5-7-9(15)11(17)13(19)12(18)10(7)16/h6H,3-5H2,1-2H3,(H,20,22)
InChIKey QZFYPJXEPFOLTD-UHFFFAOYSA-N
Molecular Weight 355.261 g/mol
SMILES C(COC(NCC(OCC=1C(F)=C(C(=C(F)C1F)F)F)=O)=O)(C)C